Difference between revisions of "CPD-17264"

Latest revision as of 11:12, 18 March 2021

common-name:
- (2e,8z,11z,14z,17z)-icosa-2,8,11,14,17-pentaenoyl-coa
smiles:
- ccc=ccc=ccc=ccc=cccccc=cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([o-])(=o)[o-])c(o)c(o1)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-]
inchi-key:
- ptromslvpfeiqj-qpyoymcksa-j
molecular-weight:
- 1047.943

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-309 ==
+== Metabolite CPD-17264 ==
 * common-name:
-** d-octopine
+** (2e,8z,11z,14z,17z)-icosa-2,8,11,14,17-pentaenoyl-coa
 * smiles:
-** cc(c([o-])=o)[n+]c(c([o-])=o)cccnc(n)=[n+]
+** ccc=ccc=ccc=ccc=cccccc=cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([o-])(=o)[o-])c(o)c(o1)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-]
 * inchi-key:
-** imxsccduafeioe-ritpcoansa-n
+** ptromslvpfeiqj-qpyoymcksa-j
 * molecular-weight:
-** 246.266
+** 1047.943
 == Reaction(s) known to consume the compound ==
-* [[D-OCTOPINE-DEHYDROGENASE-RXN]]
 == Reaction(s) known to produce the compound ==
-* [[1.5.1.11-RXN]]
+* [[RXN-16021]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=d-octopine}}
+{{#set: common-name=(2e,8z,11z,14z,17z)-icosa-2,8,11,14,17-pentaenoyl-coa}}
-{{#set: inchi-key=inchikey=imxsccduafeioe-ritpcoansa-n}}
+{{#set: inchi-key=inchikey=ptromslvpfeiqj-qpyoymcksa-j}}
-{{#set: molecular-weight=246.266}}
+{{#set: molecular-weight=1047.943}}